N-[(4-bromanyl-5-methyl-thiophen-2-yl)methylideneamino]-2-pyridin-1-ium-3-yl-ethanamide

Systemtic Name: N-[(4-bromanyl-5-methyl-thiophen-2-yl)methylideneamino]-2-pyridin-1-ium-3-yl-ethanamide Openeye Name: N-[(4-bromo-5-methyl-2-thienyl)methyleneamino]-2-pyridin-1-ium-3-yl-acetamide CAS Name: N-[(4-bromo-5-methyl-2-thiophenyl)methylideneamino]-2-(3-pyridin-1-iumyl)acetamide IUPAC Name: N-[(4-bromo-5-methylthiophen-2-yl)methylideneamino]-2-pyridin-1-ium-3-ylacetamide Traditional Name: N-[(4-bromo-5-methyl-2-thienyl)methyleneamino]-2-pyridin-1-ium-3-yl-acetamide Formula: C13H13BrN3OS+ MolecularWeight: 339.23082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C=NNC(=O)CC2=C[NH+]=CC=C2)Br

Isomeric SMILES

CC1=C(C=C(S1)C=NNC(=O)CC2=C[NH+]=CC=C2)Br

InChI

InChI=1S/C13H12BrN3OS/c1-9-12(14)6-11(19-9)8-16-17-13(18)5-10-3-2-4-15-7-10/h2-4,6-8H,5H2,1H3,(H,17,18)/p+1